N-(5-bromanylpyridin-2-yl)-2-[[4-(2-methoxyethyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(5-bromanylpyridin-2-yl)-2-[[4-(2-methoxyethyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(5-bromo-2-pyridyl)-2-[[4-(2-methoxyethyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(5-bromo-2-pyridinyl)-2-[[4-(2-methoxyethyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(5-bromopyridin-2-yl)-2-[[4-(2-methoxyethyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(5-bromo-2-pyridyl)-2-[[4-(2-methoxyethyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C17H17BrN6O2S MolecularWeight: 449.32488

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=NN=C1SCC(=O)NC2=NC=C(C=C2)Br)C3=CC=NC=C3

Isomeric SMILES

COCCN1C(=NN=C1SCC(=O)NC2=NC=C(C=C2)Br)C3=CC=NC=C3

InChI

InChI=1S/C17H17BrN6O2S/c1-26-9-8-24-16(12-4-6-19-7-5-12)22-23-17(24)27-11-15(25)21-14-3-2-13(18)10-20-14/h2-7,10H,8-9,11H2,1H3,(H,20,21,25)